CID 155895557

Tert-butyl n-[1-(hydroxymethyl)-3,3-dimethylcyclobutyl]carbamate

Structural Information

Molecular Formula
C12H23NO3
SMILES
CC1(CC(C1)(CO)NC(=O)OC(C)(C)C)C
InChI
InChI=1S/C12H23NO3/c1-10(2,3)16-9(15)13-12(8-14)6-11(4,5)7-12/h14H,6-8H2,1-5H3,(H,13,15)
InChIKey
IHXPPFQXYWBYLL-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(hydroxymethyl)-3,3-dimethylcyclobutyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.1678 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.17508 158.5
[M+Na]+ 252.15702 161.3
[M+NH4]+ 247.20162 163.1
[M+K]+ 268.13096 156.3
[M-H]- 228.16052 154.8
[M+Na-2H]- 250.14247 160.7
[M]+ 229.16725 156.7
[M]- 229.16835 156.7
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

No patent data available for this compound.