CID 72207356

Cis-tert-butyl 3-hydroxy-3-methylcyclobutylcarbamate

Structural Information

Molecular Formula
C10H19NO3
SMILES
CC1(CC(C1)NC(=O)OC(C)(C)C)O
InChI
InChI=1S/C10H19NO3/c1-9(2,3)14-8(12)11-7-5-10(4,13)6-7/h7,13H,5-6H2,1-4H3,(H,11,12)
InChIKey
MDBARZYXJRKEAH-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-hydroxy-3-methylcyclobutyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

45
Patents

201.13649 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.14377 149.4
[M+Na]+ 224.12571 153.8
[M-H]- 200.12921 151.6
[M+NH4]+ 219.17031 163.3
[M+K]+ 240.09965 156.6
[M+H-H2O]+ 184.13375 140.4
[M+HCOO]- 246.13469 167.7
[M+CH3COO]- 260.15034 187.7
[M+Na-2H]- 222.11116 153.4
[M]+ 201.13594 157.9
[M]- 201.13704 157.9
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