CID 23534

Cyclamen aldehyde diethyl acetal

Structural Information

Molecular Formula
C17H28O2
SMILES
CCOC(C(C)CC1=CC=C(C=C1)C(C)C)OCC
InChI
InChI=1S/C17H28O2/c1-6-18-17(19-7-2)14(5)12-15-8-10-16(11-9-15)13(3)4/h8-11,13-14,17H,6-7,12H2,1-5H3
InChIKey
YZGBDMRJUNSBTG-UHFFFAOYSA-N
Compound name
1-(3,3-diethoxy-2-methylpropyl)-4-propan-2-ylbenzene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

264.20892 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.21620 166.3
[M+Na]+ 287.19814 177.0
[M+NH4]+ 282.24274 173.7
[M+K]+ 303.17208 170.7
[M-H]- 263.20164 167.8
[M+Na-2H]- 285.18359 170.8
[M]+ 264.20837 168.2
[M]- 264.20947 168.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.