CID 21525235

1463522-68-0

Structural Information

Molecular Formula
C10H17NO4
SMILES
CC(C)(C)OC(=O)NC1(CC1)CC(=O)O
InChI
InChI=1S/C10H17NO4/c1-9(2,3)15-8(14)11-10(4-5-10)6-7(12)13/h4-6H2,1-3H3,(H,11,14)(H,12,13)
InChIKey
OGHYBYYNJOTBHJ-UHFFFAOYSA-N
Compound name
2-[1-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropyl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

119
Patents

215.11575 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.12303 147.5
[M+Na]+ 238.10497 155.0
[M-H]- 214.10847 150.9
[M+NH4]+ 233.14957 162.4
[M+K]+ 254.07891 153.9
[M+H-H2O]+ 198.11301 143.6
[M+HCOO]- 260.11395 167.4
[M+CH3COO]- 274.12960 188.8
[M+Na-2H]- 236.09042 152.7
[M]+ 215.11520 151.9
[M]- 215.11630 151.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe