CID 9930318

Tri-boc-hydrazinoacetic acid

Structural Information

Molecular Formula
C17H30N2O8
SMILES
CC(C)(C)OC(=O)N(CC(=O)O)N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C
InChI
InChI=1S/C17H30N2O8/c1-15(2,3)25-12(22)18(10-11(20)21)19(13(23)26-16(4,5)6)14(24)27-17(7,8)9/h10H2,1-9H3,(H,20,21)
InChIKey
FSRNHDLQBNOYJK-UHFFFAOYSA-N
Compound name
2-[[bis[(2-methylpropan-2-yl)oxycarbonyl]amino]-[(2-methylpropan-2-yl)oxycarbonyl]amino]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

61
Patents

390.20023 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.20751 194.0
[M+Na]+ 413.18945 206.5
[M-H]- 389.19295 208.4
[M+NH4]+ 408.23405 211.4
[M+K]+ 429.16339 202.5
[M+H-H2O]+ 373.19749 193.9
[M+HCOO]- 435.19843 200.9
[M+CH3COO]- 449.21408 225.1
[M+Na-2H]- 411.17490 190.3
[M]+ 390.19968 197.6
[M]- 390.20078 197.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe