CID 155858686

2580191-05-3

Structural Information

Molecular Formula
C14H25NO3
SMILES
CC(C)(C)C1CC(C1)(C=O)NC(=O)OC(C)(C)C
InChI
InChI=1S/C14H25NO3/c1-12(2,3)10-7-14(8-10,9-16)15-11(17)18-13(4,5)6/h9-10H,7-8H2,1-6H3,(H,15,17)
InChIKey
RTQLTZMROYPMJG-UHFFFAOYSA-N
Compound name
tert-butyl N-(3-tert-butyl-1-formylcyclobutyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.18344 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.19072 164.5
[M+Na]+ 278.17266 168.4
[M-H]- 254.17616 167.8
[M+NH4]+ 273.21726 177.1
[M+K]+ 294.14660 171.2
[M+H-H2O]+ 238.18070 155.6
[M+HCOO]- 300.18164 181.8
[M+CH3COO]- 314.19729 200.8
[M+Na-2H]- 276.15811 168.2
[M]+ 255.18289 175.1
[M]- 255.18399 175.1
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.