CID 10352385

(1-formylcyclopropyl)carbamic acid tert-butyl ester

Structural Information

Molecular Formula
C9H15NO3
SMILES
CC(C)(C)OC(=O)NC1(CC1)C=O
InChI
InChI=1S/C9H15NO3/c1-8(2,3)13-7(12)10-9(6-11)4-5-9/h6H,4-5H2,1-3H3,(H,10,12)
InChIKey
ACMHCEYCNRURST-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-formylcyclopropyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

410
Patents

185.1052 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.11248 141.6
[M+Na]+ 208.09442 150.3
[M-H]- 184.09792 146.6
[M+NH4]+ 203.13902 158.5
[M+K]+ 224.06836 149.5
[M+H-H2O]+ 168.10246 137.5
[M+HCOO]- 230.10340 164.0
[M+CH3COO]- 244.11905 185.5
[M+Na-2H]- 206.07987 148.7
[M]+ 185.10465 146.6
[M]- 185.10575 146.6
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