CID 14358262

119145-87-8

Structural Information

Molecular Formula
C10H17NO4
SMILES
CC(C)(C)OC(=O)N(C)C1(CC1)C(=O)O
InChI
InChI=1S/C10H17NO4/c1-9(2,3)15-8(14)11(4)10(5-6-10)7(12)13/h5-6H2,1-4H3,(H,12,13)
InChIKey
SGWWJFJPLPQMBP-UHFFFAOYSA-N
Compound name
1-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

148
Patents

215.11575 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.12303 147.1
[M+Na]+ 238.10497 154.8
[M-H]- 214.10847 151.9
[M+NH4]+ 233.14957 162.7
[M+K]+ 254.07891 155.1
[M+H-H2O]+ 198.11301 143.2
[M+HCOO]- 260.11395 167.5
[M+CH3COO]- 274.12960 192.1
[M+Na-2H]- 236.09042 151.7
[M]+ 215.11520 152.7
[M]- 215.11630 152.7
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