CID 33856

Brn 1244426

Structural Information

Molecular Formula
C10H17NO4
SMILES
C1CCC2(CC1)OCC(O2)COC(=O)N
InChI
InChI=1S/C10H17NO4/c11-9(12)13-6-8-7-14-10(15-8)4-2-1-3-5-10/h8H,1-7H2,(H2,11,12)
InChIKey
RDESHSVNCKVUPO-UHFFFAOYSA-N
Compound name
1,4-dioxaspiro[4.5]decan-3-ylmethyl carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.11575 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.123026 147.2
[M+Na]+ 238.104968 151.1
[M-H]- 214.108474 152.5
[M+NH4]+ 233.149573 166.0
[M+K]+ 254.078908 152.6
[M+H-H2O]+ 198.113010 141.8
[M+HCOO]- 260.113951 164.9
[M+CH3COO]- 274.129601 183.8
[M+Na-2H]- 236.090416 151.8
[M]+ 215.11520142 143.4
[M]- 215.11629858 143.4
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.