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]+ 216.12303 147.2
[M+Na]+ 238.10497 151.1
[M-H]- 214.10847 152.5
[M+NH4]+ 233.14957 166.0
[M+K]+ 254.07891 152.6
[M+H-H2O]+ 198.11301 141.8
[M+HCOO]- 260.11395 164.9
[M+CH3COO]- 274.12960 183.8
[M+Na-2H]- 236.09042 151.8
[M]+ 215.11520 143.4
[M]- 215.11630 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.