CID 22325154

959905-06-7

Structural Information

Molecular Formula
C11H19NO4
SMILES
CC(C)(C)OC(=O)N(C)C1(CC1)CC(=O)O
InChI
InChI=1S/C11H19NO4/c1-10(2,3)16-9(15)12(4)11(5-6-11)7-8(13)14/h5-7H2,1-4H3,(H,13,14)
InChIKey
SHBMTBLHTGBEMO-UHFFFAOYSA-N
Compound name
2-[1-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclopropyl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

229.13141 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.13869 151.4
[M+Na]+ 252.12063 158.7
[M-H]- 228.12413 156.0
[M+NH4]+ 247.16523 166.4
[M+K]+ 268.09457 158.7
[M+H-H2O]+ 212.12867 147.3
[M+HCOO]- 274.12961 171.4
[M+CH3COO]- 288.14526 194.9
[M+Na-2H]- 250.10608 155.5
[M]+ 229.13086 157.4
[M]- 229.13196 157.4
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